Y200-4999 Screening compound: 2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)butanamide

Y200-4999 Screening compound: 2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)butanamide
Y200-4999 Screening compound: 2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-4999
2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)butanamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y200-4999

Molecular Formula

C8H13N3OS (C8 H13 N3 OS)

Compound Name

2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)butanamide

IUPAC name

22-dimethyl-N-(134-thiadiazol-2-yl)butanamide

SMILES

CCC(C)(C)C(Nc1nncs1)=O

InChI

InChI=1S/C8H13N3OS/c1-4-8(2,3)6(12)10-7-11-9-5-13-7/h5H,4H2,1-3H3,(H,10,11,12)

InChI Key

OFZZYWZYUYRSFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02862586

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

199.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.075

Distribution Coefficient, logD

2.049

Water Solubility, LogSw

-2.55

Polar Surface Area

47.177

Acid Dissociation Constant (pKa)

8.61

Base Dissociation Constant (pKb)

-2.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

Y200-4999 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Fragments Library (11262 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Proteases
  • Nuclear receptors
Structure:
  • Fragments
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y200-4999 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-4999?
Check Price and Availability of Y200-4999, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y200-4999 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-4999
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-4999
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y200-4999 available by request